Information card for entry 7054682

Structure parameters

• Formula: C15 H17 I N4 Pt
• Calculated formula: C15 H17 I N4 Pt
• SMILES: [Pt](I)([n]1ccc(cc1)C#N)([n]1ccc(cc1)C#N)(C)(C)C
• Title of publication: Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines
• Authors of publication: Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine
• Journal of publication: New J. Chem.
• Year of publication: 2015
• Journal volume: 39
• Journal issue: 5
• Pages of publication: 3536
• a: 9.7124 ± 0.0005 Å
• b: 10.2867 ± 0.0005 Å
• c: 10.3892 ± 0.0005 Å
• α: 70.911 ± 0.003°
• β: 66.286 ± 0.003°
• γ: 73.069 ± 0.003°
• Cell volume: 882.64 ± 0.08 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0235
• Residual factor for significantly intense reflections: 0.0215
• Weighted residual factors for significantly intense reflections: 0.0508
• Weighted residual factors for all reflections included in the refinement: 0.0514
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No